dimethyl 4-(3-bromophenyl)-1-(4-fluorophenyl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 4-(3-bromophenyl)-1-(4-fluorophenyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: dimethyl 4-(3-bromophenyl)-1-(4-fluorophenyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 4-(3-bromophenyl)-1-(4-fluorophenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-(3-bromophenyl)-1-(4-fluorophenyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 4-(3-bromophenyl)-1-(4-fluorophenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C21H17BrFNO4 MolecularWeight: 446.266383

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C=C(C1C2=CC(=CC=C2)Br)C(=O)OC)C3=CC=C(C=C3)F

Isomeric SMILES

COC(=O)C1=CN(C=C(C1C2=CC(=CC=C2)Br)C(=O)OC)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H17BrFNO4/c1-27-20(25)17-11-24(16-8-6-15(23)7-9-16)12-18(21(26)28-2)19(17)13-4-3-5-14(22)10-13/h3-12,19H,1-2H3